Connecting molecular dynamics to micromorphic theory. I: Instantaneous and averaged mechanical variables

DOI10.1016/S0378-4371(02)01921-0zbMath1076.74502MaRDI QIDQ1866949

James D. Lee, Youping Chen

Publication date: 23 April 2003

Published in: Physica A (Search for Journal in Brave)

zbMATH Keywords

balance lawscontinuum theorystatistical ensemble average

Mathematics Subject Classification ID

Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics (82B21) Molecular, statistical, and kinetic theories in solid mechanics (74A25)

Related Items (22)

High-frequency antiplane wave propagation in ultra-thin films with nanostructures ⋮ A multiscale molecular dynamics method for isothermal dynamic problems using the seamless heterogeneous multiscale method ⋮ A geometrically exact micromorphic model for elastic metallic foams accounting for affine microstructure. Modelling, existence of minimizers, identification of moduli and computational results ⋮ Micromorphic approach to single crystal plasticity and damage ⋮ Scaling and hierarchies of wave motion in solids ⋮ Coarse-grained atomistic simulation of dislocations ⋮ A parallel algorithm for the concurrent atomistic-continuum methodology ⋮ Coarse-graining molecular dynamics models using an extended Galerkin projection method ⋮ Micromorphic modeling of granular dynamics ⋮ Large elastic deformation of micromorphic shells. Part I: Variational formulation ⋮ Asymmetry of the atomic-level stress tensor in homogeneous and inhomogeneous materials ⋮ Effective description of anisotropic wave dispersion in mechanical band-gap metamaterials via the relaxed micromorphic model ⋮ Modeling phononic crystals via the weighted relaxed micromorphic model with free and gradient micro-inertia ⋮ Microcontinuum balance equations revisited: The mesoscopic approach ⋮ A material frame approach for evaluating continuum variables in atomistic simulations ⋮ Extending Micromorphic Theory to Atomic Scale ⋮ A mesoscopic continuum description of dry granular materials ⋮ Microcontinuum derivation of Goodman-Cowin theory for granular materials ⋮ An atomistic-to-continuum molecular dynamics: theory, algorithm, and applications ⋮ Description of local dilatancy and local rotation of granular assemblies by microstretch modeling ⋮ On the statics and dynamics of granular-microstructured rods with higher order effects ⋮ Reviewing the roots of continuum formulations in molecular systems. Part I: Particle dynamics, statistical physics, mass and linear momentum balance equations

Cites Work

• Examining the physical foundation of continuum theories from the viewpoint of phonon dispersion relation
• Nonlinear theory of simple micro-elastic solids. I
• Microcontinuum Field Theories
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